Chemical Properties of Glycerol, 1-C15, 2-C15, TMS

InChI

InChI=1S/C36H72O5Si/c1-6-8-10-12-14-16-18-20-22-24-26-28-30-35(37)39-32-34(33-40-42(3,4)5)41-36(38)31-29-27-25-23-21-19-17-15-13-11-9-7-2/h34H,6-33H2,1-5H3

InChI Key

RQEFBUVYTLETAI-UHFFFAOYSA-N

Formula

C36H72O5Si

SMILES

CCCCCCCCCCCCCCC(=O)OCC(CO[Si](C)(C)C)OC(=O)CCCCCCCCCCCCCC

Molecular Weight¹

613.04

• ω : Acentric Factor.
• Δ_fG° : Standard Gibbs free energy of formation (kJ/mol).
• Δ_fH°_gas : Enthalpy of formation at standard conditions (kJ/mol).
• Δ_vapH° : Enthalpy of vaporization at standard conditions (kJ/mol).
• IE : Ionization energy (eV).
• log₁₀WS : Log10 of Water solubility in mol/l.
• logP_oct/wat : Octanol/Water partition coefficient.
• P_c : Critical Pressure (kPa).
• I_np : Non-polar retention indices.
• T_boil : Normal Boiling Point Temperature (K).
• T_c : Critical Temperature (K).
• T_fus : Normal melting (fusion) point (K).
• V_c : Critical Volume (m³/kmol).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Property	Value	Unit	Source
ω	1.5416		Relay (1.0) Calculated Property
ΔfG°	-341.86	kJ/mol	Relay (1.0-beta) Calculated Property
ΔfH°gas	-1631.19	kJ/mol	Relay (1.0) Calculated Property
ΔvapH°	156.96	kJ/mol	Relay (1.0) Calculated Property
IE	10.05	eV	Relay (1.0) Calculated Property
log10WS	-9.52		Relay (1.0) Calculated Property
logPoct/wat	11.475		Crippen Calculated Property
Pc	-487.12	kPa	Relay (1.0-beta) Calculated Property
Inp	[3536.00; 3536.00]
Inp	3536.00		NIST
Inp	3536.00		NIST
Tboil	725.26	K	Relay (1.0) Calculated Property
Tc	875.54	K	Relay (1.0) Calculated Property
Tfus	304.02	K	Relay (1.0) Calculated Property
Vc	2.174	m3/kmol	Relay (1.0) Calculated Property

Similar Compounds

Find more compounds similar to Glycerol, 1-C15, 2-C15, TMS.

Sources

• Cheméo Relay (1.0)
• Cheméo Relay (1.0, beta) Beta: served but experimental, data-limited and below our cross-validation release bar; the Joback value is recommended where available.
• Crippen Method
• Crippen Method
• NIST Webbook

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